N-(4-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine

C17H11ClN4S — CID 118736891

IUPACN-(4-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine
SMILESClc1ccc(Nc2ncnc3ccc(-c4cncs4)cc23)cc1
InChIInChI=1S/C17H11ClN4S/c18-12-2-4-13(5-3-12)22-17-14-7-11(16-8-19-10-23-16)1-6-15(14)20-9-21-17/h1-10H,(H,20,21,22)
InChIKeyNMBAKNSXUASOOK-UHFFFAOYSA-N
MW338.82 g/mol
LogP5.15
Rot. Bonds3

About N-(4-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine

N-(4-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine (PubChem CID 118736891) has the molecular formula C17H11ClN4S and a molecular weight of 338.82 g/mol. Its IUPAC name is N-(4-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine.

Molecular Properties

Compound NameN-(4-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine
PubChem CID118736891
Molecular FormulaC17H11ClN4S
Molecular Weight338.82 g/mol
Exact Mass338.04
IUPAC NameN-(4-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine
SMILESClc1ccc(Nc2ncnc3ccc(-c4cncs4)cc23)cc1
InChIInChI=1S/C17H11ClN4S/c18-12-2-4-13(5-3-12)22-17-14-7-11(16-8-19-10-23-16)1-6-15(14)20-9-21-17/h1-10H,(H,20,21,22)
InChIKeyNMBAKNSXUASOOK-UHFFFAOYSA-N
XLogP5.15
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.82
LogP ≤ 55.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(4-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Timegadine
CID 68902
6-Thiazolylquinazoline 1
CID 5329475
5-methyl-N-(2-phenylquinazolin-4-yl)thiazol-2-amine
CID 10236668
2-(4-methylthiazol-2-yl)-N-(pyridin-4-yl)quinazolin-4-amine
CID 10358578
4-(5-(4-chlorophenyl)thiophen-2-yl)-N-(pyridin-3-ylmethyl)quinazolin-2-amine
CID 49786171
5-(6-(2-Chlorophenyl)-2-(pyridin-2-yl)pyrimidin-4-yl)thiazol-2-amine
CID 52941436
5-(6-(2-Chlorophenyl)pyrimidin-4-yl)-n-isopropylthiazol-2-amine
CID 52941551
5-(6-(2-Chlorophenyl)-2-(pyridin-2-yl)pyrimidin-4-yl)-n-isopropylthiazol-2-amine
CID 52942728
5-(6-(2-Chlorophenyl)-2-(pyridin-2-yl)pyrimidin-4-yl)-n-ethylthiazol-2-amine
CID 52943899
5-(6-(2-Chlorophenyl)-2-(pyridin-2-yl)pyrimidin-4-yl)-n-cyclobutylthiazol-2-amine
CID 52943906
(S)-N-sec-butyl-5-(6-(2-chlorophenyl)-2-(pyridin-2-yl)pyrimidin-4-yl)thiazol-2-amine
CID 52946367
5-(6-(2-Chlorophenyl)-2-(pyridin-2-yl)pyrimidin-4-yl)-n-propylthiazol-2-amine
CID 52947439

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine?
The IUPAC name of N-(4-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine (CID 118736891) is N-(4-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine.
What is the SMILES notation for N-(4-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine?
The canonical SMILES for N-(4-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine is Clc1ccc(Nc2ncnc3ccc(-c4cncs4)cc23)cc1.
What is the InChIKey of N-(4-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine?
The InChIKey is NMBAKNSXUASOOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11ClN4S/c18-12-2-4-13(5-3-12)22-17-14-7-11(16-8-19-10-23-16)1-6-15(14)20-9-21-17/h1-10H,(H,20,21,22).
What are the key properties of N-(4-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine?
N-(4-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine has a molecular weight of 338.82 g/mol, XLogP of 5.15, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-6-(1,3-thiazol-5-yl)quinazolin-4-amine is sourced from PubChem (CID 118736891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).